C203H196N62O11 — CID 161366451
N-[5-(6-acetamido-3-pyridinyl)-2-pyridinyl]-2-[3-methyl-4-(2-methyl-4-pyridinyl)pyrazol-1-yl]acetamide;N-[5-[2-(dimethylamino)-4-pyridinyl]-2-pyridinyl]-2-[3-methyl-4-(2-methyl-4-pyridinyl)pyrazol-1-yl]acetamide;N-[5-[6-(dimethylamino)-3-pyridinyl]-2-pyridinyl]-2-[3-methyl-4-(2-methyl-4-pyridinyl)pyrazol-1-yl]acetamide;2-[3,5-dimethyl-4-(2-methyl-4-pyridinyl)pyrazol-1-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide;2-[3,5-dimethyl-4-(6-methyl-3-pyridinyl)pyrazol-1-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide;2-[3,5-dimethyl-4-(6-methyl-3-pyridinyl)pyrazol-1-yl]-N-(5-pyrimidin-5-yl-2-pyridinyl)acetamide;N-[5-(6-methoxy-3-pyridinyl)-2-pyridinyl]-2-[3-methyl-4-(2-methyl-4-pyridinyl)pyrazol-1-yl]acetamide;2-[3-methyl-4-(2-methyl-4-pyridinyl)pyrazol-1-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide;2-[3-methyl-4-(2-methyl-4-pyridinyl)pyrazol-1-yl]-N-(5-pyrimidin-5-yl-2-pyridinyl)acetamide (PubChem CID 161366451) has the molecular formula C203H196N62O11 and a molecular weight of 3680.22 g/mol. Its IUPAC name is N-[5-(6-acetamido-3-pyridinyl)-2-pyridinyl]-2-[3-methyl-4-(2-methyl-4-pyridinyl)pyrazol-1-yl]acetamide;N-[5-[2-(dimethylamino)-4-pyridinyl]-2-pyridinyl]-2-[3-methyl-4-(2-methyl-4-pyridinyl)pyrazol-1-yl]acetamide;N-[5-[6-(dimethylamino)-3-pyridinyl]-2-pyridinyl]-2-[3-methyl-4-(2-methyl-4-pyridinyl)pyrazol-1-yl]acetamide;2-[3,5-dimethyl-4-(2-methyl-4-pyridinyl)pyrazol-1-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide;2-[3,5-dimethyl-4-(6-methyl-3-pyridinyl)pyrazol-1-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide;2-[3,5-dimethyl-4-(6-methyl-3-pyridinyl)pyrazol-1-yl]-N-(5-pyrimidin-5-yl-2-pyridinyl)acetamide;N-[5-(6-methoxy-3-pyridinyl)-2-pyridinyl]-2-[3-methyl-4-(2-methyl-4-pyridinyl)pyrazol-1-yl]acetamide;2-[3-methyl-4-(2-methyl-4-pyridinyl)pyrazol-1-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide;2-[3-methyl-4-(2-methyl-4-pyridinyl)pyrazol-1-yl]-N-(5-pyrimidin-5-yl-2-pyridinyl)acetamide.
| Compound Name | N-[5-(6-acetamido-3-pyridinyl)-2-pyridinyl]-2-[3-methyl-4-(2-methyl-4-pyridinyl)pyrazol-1-yl]acetamide;N-[5-[2-(dimethylamino)-4-pyridinyl]-2-pyridinyl]-2-[3-methyl-4-(2-methyl-4-pyridinyl)pyrazol-1-yl]acetamide;N-[5-[6-(dimethylamino)-3-pyridinyl]-2-pyridinyl]-2-[3-methyl-4-(2-methyl-4-pyridinyl)pyrazol-1-yl]acetamide;2-[3,5-dimethyl-4-(2-methyl-4-pyridinyl)pyrazol-1-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide;2-[3,5-dimethyl-4-(6-methyl-3-pyridinyl)pyrazol-1-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide;2-[3,5-dimethyl-4-(6-methyl-3-pyridinyl)pyrazol-1-yl]-N-(5-pyrimidin-5-yl-2-pyridinyl)acetamide;N-[5-(6-methoxy-3-pyridinyl)-2-pyridinyl]-2-[3-methyl-4-(2-methyl-4-pyridinyl)pyrazol-1-yl]acetamide;2-[3-methyl-4-(2-methyl-4-pyridinyl)pyrazol-1-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide;2-[3-methyl-4-(2-methyl-4-pyridinyl)pyrazol-1-yl]-N-(5-pyrimidin-5-yl-2-pyridinyl)acetamide |
|---|---|
| PubChem CID | 161366451 |
| Molecular Formula | C203H196N62O11 |
| Molecular Weight | 3680.22 g/mol |
| Exact Mass | 3677.67 |
| IUPAC Name | N-[5-(6-acetamido-3-pyridinyl)-2-pyridinyl]-2-[3-methyl-4-(2-methyl-4-pyridinyl)pyrazol-1-yl]acetamide;N-[5-[2-(dimethylamino)-4-pyridinyl]-2-pyridinyl]-2-[3-methyl-4-(2-methyl-4-pyridinyl)pyrazol-1-yl]acetamide;N-[5-[6-(dimethylamino)-3-pyridinyl]-2-pyridinyl]-2-[3-methyl-4-(2-methyl-4-pyridinyl)pyrazol-1-yl]acetamide;2-[3,5-dimethyl-4-(2-methyl-4-pyridinyl)pyrazol-1-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide;2-[3,5-dimethyl-4-(6-methyl-3-pyridinyl)pyrazol-1-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide;2-[3,5-dimethyl-4-(6-methyl-3-pyridinyl)pyrazol-1-yl]-N-(5-pyrimidin-5-yl-2-pyridinyl)acetamide;N-[5-(6-methoxy-3-pyridinyl)-2-pyridinyl]-2-[3-methyl-4-(2-methyl-4-pyridinyl)pyrazol-1-yl]acetamide;2-[3-methyl-4-(2-methyl-4-pyridinyl)pyrazol-1-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide;2-[3-methyl-4-(2-methyl-4-pyridinyl)pyrazol-1-yl]-N-(5-pyrimidin-5-yl-2-pyridinyl)acetamide |
| SMILES | CC(=O)Nc1ccc(-c2ccc(NC(=O)Cn3cc(-c4ccnc(C)c4)c(C)n3)nc2)cn1.COc1ccc(-c2ccc(NC(=O)Cn3cc(-c4ccnc(C)c4)c(C)n3)nc2)cn1.Cc1cc(-c2c(C)nn(CC(=O)Nc3ccc(-c4cnccn4)cn3)c2C)ccn1.Cc1cc(-c2cn(CC(=O)Nc3ccc(-c4ccc(N(C)C)nc4)cn3)nc2C)ccn1.Cc1cc(-c2cn(CC(=O)Nc3ccc(-c4ccnc(N(C)C)c4)cn3)nc2C)ccn1.Cc1cc(-c2cn(CC(=O)Nc3ccc(-c4cnccn4)cn3)nc2C)ccn1.Cc1cc(-c2cn(CC(=O)Nc3ccc(-c4cncnc4)cn3)nc2C)ccn1.Cc1ccc(-c2c(C)nn(CC(=O)Nc3ccc(-c4cnccn4)cn3)c2C)cn1.Cc1ccc(-c2c(C)nn(CC(=O)Nc3ccc(-c4cncnc4)cn3)c2C)cn1 |
| InChI | InChI=1S/C24H23N7O2.2C24H25N7O.C23H22N6O2.3C22H21N7O.2C21H19N7O/c1-15-10-18(8-9-25-15)21-13-31(30-16(21)2)14-24(33)29-23-7-5-20(12-27-23)19-4-6-22(26-11-19)28-17(3)32;1-16-11-18(9-10-25-16)21-14-31(29-17(21)2)15-24(32)28-22-7-5-19(12-26-22)20-6-8-23(27-13-20)30(3)4;1-16-11-19(8-9-25-16)21-14-31(29-17(21)2)15-24(32)28-22-6-5-20(13-27-22)18-7-10-26-23(12-18)30(3)4;1-15-10-17(8-9-24-15)20-13-29(28-16(20)2)14-22(30)27-21-6-4-18(11-25-21)19-5-7-23(31-3)26-12-19;1-14-4-5-18(11-25-14)22-15(2)28-29(16(22)3)12-21(30)27-20-7-6-17(10-26-20)19-8-23-13-24-9-19;1-14-10-17(6-7-24-14)22-15(2)28-29(16(22)3)13-21(30)27-20-5-4-18(11-26-20)19-12-23-8-9-25-19;1-14-4-5-18(11-25-14)22-15(2)28-29(16(22)3)13-21(30)27-20-7-6-17(10-26-20)19-12-23-8-9-24-19;1-14-7-16(5-6-24-14)19-11-28(27-15(19)2)12-21(29)26-20-4-3-17(10-25-20)18-8-22-13-23-9-18;1-14-9-16(5-6-23-14)18-12-28(27-15(18)2)13-21(29)26-20-4-3-17(10-25-20)19-11-22-7-8-24-19/h4-13H,14H2,1-3H3,(H,26,28,32)(H,27,29,33);5-14H,15H2,1-4H3,(H,26,28,32);5-14H,15H2,1-4H3,(H,27,28,32);4-13H,14H2,1-3H3,(H,25,27,30);4-11,13H,12H2,1-3H3,(H,26,27,30);2*4-12H,13H2,1-3H3,(H,26,27,30);3-11,13H,12H2,1-2H3,(H,25,26,29);3-12H,13H2,1-2H3,(H,25,26,29) |
| InChIKey | VPWKIKYEKUVRMK-UHFFFAOYSA-N |
| XLogP | 30.92 |
| TPSA | 879.57 Ų |
| H-Bond Donors | 10 |
| H-Bond Acceptors | 63 |
| Rotatable Bonds | 49 |
| Heavy Atoms | 276 |
| Complexity | — |
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 3680.22 |
| LogP ≤ 5 | 30.92 |
| H-Bond Donors ≤ 5 | 10 |
| H-Bond Acceptors ≤ 10 | 63 |